2-[methyl-(2,4,6-trimethylphenyl)sulfonyl-amino]ethanoic acid

Systemtic Name: 2-[methyl-(2,4,6-trimethylphenyl)sulfonyl-amino]ethanoic acid Openeye Name: 2-[methyl-(2,4,6-trimethylphenyl)sulfonyl-amino]acetic acid CAS Name: 2-[methyl-(2,4,6-trimethylphenyl)sulfonylamino]acetic acid IUPAC Name: 2-[methyl-(2,4,6-trimethylphenyl)sulfonylamino]acetic acid Traditional Name: 2-[mesitylsulfonyl(methyl)amino]acetic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(C)CC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(C)CC(=O)O)C

InChI

InChI=1S/C12H17NO4S/c1-8-5-9(2)12(10(3)6-8)18(16,17)13(4)7-11(14)15/h5-6H,7H2,1-4H3,(H,14,15)